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Reference substances

Reference substances

IUPAC name:
5-(2-Fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde

Inventory

CAS number:
881677-11-8
Synonyms
Names:
5-(2-Fluorophenyl)-1-(3-pyridinylsulfonyl)-1H-pyrrole-3-carboxaldehyde
5-(2-Fluorophenyl)-1-[(pyridin-3-yl)sulfonyl]-1H-pyrrole-3-carboxaldehyde
PSPA
Identifier:
IUPAC name
1H-Pyrrole-3-carboxaldehyde, 5-(2-fluorophenyl)-1-(3-pyridinylsulfonyl)
Identifier:
other: SMILES notation
O=S(N1C(C2=C(F)C=CC=C2)=CC(C=O)=C1)(C3=CN=CC=C3)=O
5-(2-Fluorophenyl)-1-(pyridin-3-ylsulfonyl)-1H-pyrrole-3-carbaldehyde

Molecular and structural information

Molecular formula:
C16H11FN2O3S
Molecular weight:
ca. 330.33
SMILES notation:
c1ccc(c(c1)c2cc(cn2S(=O)(=O)c3cccnc3)C=O)F
InChl:
InChI=1S/C16H11FN2O3S/c17-15-6-2-1-5-14(15)16-8-12(11-20)10-19(16)23(21,22)13-4-3-7-18-9-13/h1-11H
Structural formula:
Chemical structure

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